{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.863932 0.363932 0 ] [ 0.363932 0.136068 0 ] [ 0.636068 0.863932 0 ] [ 0.136068 0.636068 0 ] [ 0.6636 0.1636 0.5 ] [ 0.1636 0.3364 0.5 ] [ 0.8364 0.6636 0.5 ] [ 0.3364 0.8364 0.5 ] ] } "species" { "source-value" [ "Al" "Al" "Cu" "Cu" "Cu" "Cu" "Re" "Re" "Re" "Re" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.91161884 "source-unit" "angstrom" } "c" { "source-value" 3.91196994 "source-unit" "angstrom" } }